SCHEMBL6676028

SCHEMBL6676028

COc1ccc(NS(=O)(=O)c2ccc(OC(F)(F)F)c(C(=O)O)c2)cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.62
HTT P42858 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
TSHR P16473 2/20 0.59
KMT2A Q03164 5/20 0.57
MEN1 O00255 4/20 0.57
ALOX15 P16050 2/20 0.57
MAPK1 P28482 2/20 0.57
ALDH1A1 P00352 3/20 0.55
GAA P10253 2/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CA12 O43570 1/20 0.53
CA9 Q16790 1/20 0.53
PKM P14618 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
POLB P06746 1/20 0.52
WDR5 P61964 1/20 0.52
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
KDM4E B2RXH2 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6675565 0.91 TSHR (0.57) LMNAHTTSMN1; SMN2TSHRKMT2A
SCHEMBL6678325 0.91 TSHR (0.57) LMNAHTTSMN1; SMN2TSHRKMT2A
SCHEMBL6679996 0.89 POLB (0.67) LMNATSHRKMT2AMEN1ALOX15
SCHEMBL7540381 0.86 POLB (0.51) LMNASMN1; SMN2TSHRKMT2AMEN1
SCHEMBL6674411 0.85 LMNA (0.67) LMNAHTTSMN1; SMN2TSHRKMT2A
SCHEMBL7542193 0.83 POLB (0.48) LMNASMN1; SMN2TSHRKMT2AMEN1
SCHEMBL6680246 0.82 LMNA (0.74) LMNAHTTSMN1; SMN2TSHRKMT2A
SCHEMBL7537023 0.81 LMNA (0.61) LMNAHTTSMN1; SMN2TSHRKMT2A
SCHEMBL1813497 0.80 TNNI3K (0.47) TSHRMAPK1POLBKDM4E
SCHEMBL6674127 0.80 LMNA (0.62) LMNAHTTSMN1; SMN2TSHRKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US claimed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP claimed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO claimed
EP-1005453-B1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE LOWERING AGENTS TULARIK INC (US) 2004-10-27 EP disclosed
US-6388131-B2 Benzenesulfonamide compounds, which encompasses the compound batabulin (2-Fluoro-1-methoxy-4-pentafluorophenylsulfonamidobenzene) TULARIK, INC. 2002-05-14 US disclosed
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US disclosed
US-6284923-B1 BENZENESULFONIMIDES FOR TREATMENT OF CANCER AND ANTICHOLESTEROL AGENTS TULARIK INC 2001-09-04 US disclosed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP disclosed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 LMNA 2006/4885HTT 4439/4885SMN1; SMN2 4446/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.